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Molecular Informatics|August 5, 2016
Screening Chemicals for Receptor-Mediated Toxicological and Pharmacological Endpoints: Using Public Data to Build Screening Tools within a KNIME WorkflowF P Steinmetz, C L Mellor, T Meinl, et al.Molecular Informatics|August 5, 2016
CS-MINER: A Tool for Association Mining in Binding-DatabaseAhmad Mani-Varnosfaderani, Abolfazl Valadkhani, Mehdi Jalali-HeraviMolecular Informatics|August 5, 2016
Enhancing the Reliability of GPCR Models by Accounting for Flexibility of Their Pro-Containing Helices: the Case of the Human mAChR1 ReceptorAlessandro Pedretti, Angelica Mazzolari, Chiara Ricci, et al.Molecular Informatics|August 5, 2016
In Silico Estimation of Chemical Carcinogenicity with Binary and Ternary Classification MethodsXiao Li, Zheng Du, Jie Wang, et al.Molecular Informatics|August 5, 2016
Multi-Component Protein - Protein Docking Based Protocol with External Scoring for Modeling Dimers of G Protein-Coupled ReceptorsAgnieszka A Kaczor, Ramon Guixà-González, Pau Carrió, et al.Molecular Informatics|August 5, 2016
GTM-Based QSAR Models and Their Applicability DomainsH A Gaspar, I I Baskin, G Marcou, et al.Molecular Informatics|August 5, 2016
Structural Characteristics of the Allosteric Binding Site Represent a Key to Subtype Selective Modulators of Muscarinic Acetylcholine ReceptorsMarcel Bermudez, Christin Rakers, Gerhard WolberMolecular Informatics|August 5, 2016
Cross-Mapping of Protein - Ligand Binding Data Between ChEMBL and PDBbindZhihai Liu, Jie Li, Jie Liu, et al.Molecular Informatics|August 5, 2016
The Evolution of Digital Chemistry at SouthamptonColin Bird, Simon J Coles, Jeremy G FreyMolecular Informatics|August 5, 2016
Cheminformatics Based Machine Learning Models for AMA1-RON2 Abrogators for Inhibiting Plasmodium falciparum Erythrocyte InvasionPriyank Maindola, Salma Jamal, Abhinav GroverPageof 101